Monomers
Ethyl 2-chloroacrylate
Identifiers
IUPAC name
ethyl 2-chloroprop-2-enoate
InchI
InChI=1S/C5H7ClO2/c1-3-8-5(7)4(2)6/h2-3H2,1H3
InchI Key
CVUNPKSKGHPMSY-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)Cl
Canonical SMILES
CCOC(=O)C(=C)Cl
Isomeric SMILES
CCOC(=O)C(=C)Cl
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H7ClO2
Heavy Atom Count
8
Molecular Weight
134.562
Exact Molecular Weight
134.0135
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.302
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
15 14 0 0 0 0 0 0 0 0999 V2000
-2.3179 0.0241 0.4899 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3549 -0.7943 -0.2898 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0130 -0.6207 0.0694 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6769 0.5740 0.0109 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0150 1.5592 -0.4019 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0883 0.6940 0.4025 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7860 -0.3305 0.8344 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9017 2.2393 0.3034 Cl 0 0 0 0 0 0 0 0 0 0 0 0
-1.8365 0.6675 1.2659 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9476 0.6642 -0.1907 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0625 -0.6000 1.0457 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5261 -0.6801 -1.3974 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5972 -1.8799 -0.0955 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3761 -1.3264 0.9321 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8117 -0.1904 1.1073 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 2 3
6 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
7 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers